Information card for entry 7059620

Structure parameters

• Formula: C36 H40 Mn2 N4 O10
• Calculated formula: C36 H40 Mn2 N4 O10
• Title of publication: Dinuclear complexes of Mn, Co, Zn and Cd assembled with 1,4-cyclohexanedicarboxylate: synthesis, crystal structures and acetonitrile fluorescence sensing properties
• Authors of publication: Rosales-Vázquez, Luis D.; Martínez-Otero, Diego; Sánchez-Mendieta, Víctor; Jaramillo-García, Jonathan; Téllez-López, Antonio; Escudero, Roberto; Morales, Francisco; Valdes-García, Josue; Dorazco-González, Alejandro
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 25
• Pages of publication: 10317 - 10325
• a: 9.7675 ± 0.0001 Å
• b: 16.109 ± 0.0002 Å
• c: 10.9117 ± 0.0001 Å
• α: 90°
• β: 101.905 ± 0.0004°
• γ: 90°
• Cell volume: 1679.97 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0291
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0645
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No